# generated using pymatgen data_Nd13Cd58 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.81137707 _cell_length_b 15.81137747 _cell_length_c 15.47186350 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999914 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd13Cd58 _chemical_formula_sum 'Nd26 Cd116' _cell_volume 3349.75206468 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nd Nd0 1 0.41059715 0.20529858 0.55211625 1.0 Nd Nd1 1 0.87160828 0.74321657 0.25000000 1.0 Nd Nd2 1 0.20529858 0.41059715 0.05211625 1.0 Nd Nd3 1 0.08703854 0.54351927 0.75000000 1.0 Nd Nd4 1 0.79470142 0.58940285 0.94788375 1.0 Nd Nd5 1 0.79470142 0.20529858 0.55211625 1.0 Nd Nd6 1 0.91296146 0.45648073 0.25000000 1.0 Nd Nd7 1 0.79470142 0.20529858 0.94788375 1.0 Nd Nd8 1 0.79470142 0.58940285 0.55211625 1.0 Nd Nd9 1 0.45648073 0.91296146 0.75000000 1.0 Nd Nd10 1 0.12839172 0.87160828 0.75000000 1.0 Nd Nd11 1 0.87160828 0.12839172 0.25000000 1.0 Nd Nd12 1 0.58940285 0.79470142 0.05211625 1.0 Nd Nd13 1 0.58940285 0.79470142 0.44788375 1.0 Nd Nd14 1 0.20529858 0.79470142 0.44788375 1.0 Nd Nd15 1 -0.00000000 0.00000000 -0.00000000 1.0 Nd Nd16 1 0.45648073 0.54351927 0.75000000 1.0 Nd Nd17 1 0.54351927 0.08703854 0.25000000 1.0 Nd Nd18 1 0.12839172 0.25678343 0.75000000 1.0 Nd Nd19 1 0.74321657 0.87160828 0.75000000 1.0 Nd Nd20 1 0.20529858 0.41059715 0.44788375 1.0 Nd Nd21 1 0.41059715 0.20529858 0.94788375 1.0 Nd Nd22 1 -0.00000000 0.00000000 0.50000000 1.0 Nd Nd23 1 0.25678343 0.12839172 0.25000000 1.0 Nd Nd24 1 0.20529858 0.79470142 0.05211625 1.0 Nd Nd25 1 0.54351927 0.45648073 0.25000000 1.0 Cd Cd26 1 0.90707452 0.09292548 0.65601179 1.0 Cd Cd27 1 1.00000000 0.19895338 -0.00000000 1.0 Cd Cd28 1 0.63487525 0.96447741 0.60213869 1.0 Cd Cd29 1 0.36512475 0.32960216 0.39786131 1.0 Cd Cd30 1 0.67039784 0.63487525 0.10213869 1.0 Cd Cd31 1 0.60050563 0.39949437 0.05119097 1.0 Cd Cd32 1 0.63487525 0.67039784 0.89786131 1.0 Cd Cd33 1 0.96447741 0.63487525 0.10213869 1.0 Cd Cd34 1 0.20101127 0.60050563 0.94880903 1.0 Cd Cd35 1 0.09292548 0.90707452 0.34398821 1.0 Cd Cd36 1 0.56133845 0.12267689 0.64570958 1.0 Cd Cd37 1 0.81414904 0.90707452 0.34398821 1.0 Cd Cd38 1 0.73253512 0.26746488 0.75000000 1.0 Cd Cd39 1 0.43866155 0.87732311 0.35429042 1.0 Cd Cd40 1 0.32960216 0.36512475 0.89786131 1.0 Cd Cd41 1 0.03552259 0.67039784 0.89786131 1.0 Cd Cd42 1 0.52974267 0.76487134 0.84207067 1.0 Cd Cd43 1 0.80104662 0.80104662 -0.00000000 1.0 Cd Cd44 1 0.36512475 0.03552259 0.39786131 1.0 Cd Cd45 1 1.00000000 0.19895338 0.50000000 1.0 Cd Cd46 1 0.91796389 0.64158683 0.75000000 1.0 Cd Cd47 1 0.19895338 0.19895338 0.50000000 1.0 Cd Cd48 1 0.67039784 0.03552259 0.10213869 1.0 Cd Cd49 1 0.60050563 0.39949437 0.44880903 1.0 Cd Cd50 1 0.76487134 0.52974267 0.34207067 1.0 Cd Cd51 1 0.76487134 0.52974267 0.15792933 1.0 Cd Cd52 1 0.96447741 0.32960216 0.10213869 1.0 Cd Cd53 1 0.66666700 0.33333300 0.59589692 1.0 Cd Cd54 1 0.27637707 0.91796389 0.25000000 1.0 Cd Cd55 1 0.47025733 0.23512866 0.34207067 1.0 Cd Cd56 1 0.03552259 0.36512475 0.60213869 1.0 Cd Cd57 1 0.33333300 0.66666700 0.75000000 1.0 Cd Cd58 1 0.72362293 0.08203611 0.75000000 1.0 Cd Cd59 1 0.03552259 0.36512475 0.89786131 1.0 Cd Cd60 1 0.80104662 0.00000000 0.50000000 1.0 Cd Cd61 1 0.60050563 0.20101127 0.44880903 1.0 Cd Cd62 1 0.67039784 0.03552259 0.39786131 1.0 Cd Cd63 1 0.35841317 0.08203611 0.75000000 1.0 Cd Cd64 1 0.91796389 0.27637707 0.75000000 1.0 Cd Cd65 1 0.00000000 0.80104662 -0.00000000 1.0 Cd Cd66 1 0.43866155 0.56133845 0.14570958 1.0 Cd Cd67 1 0.12267689 0.56133845 0.35429042 1.0 Cd Cd68 1 0.50000000 0.00000000 0.50000000 1.0 Cd Cd69 1 0.90707452 0.81414904 0.84398821 1.0 Cd Cd70 1 0.09292548 0.18585096 0.15601179 1.0 Cd Cd71 1 0.03552259 0.67039784 0.60213869 1.0 Cd Cd72 1 0.32960216 0.36512475 0.60213869 1.0 Cd Cd73 1 0.56133845 0.12267689 0.85429042 1.0 Cd Cd74 1 0.20101127 0.60050563 0.55119097 1.0 Cd Cd75 1 0.63487525 0.67039784 0.60213869 1.0 Cd Cd76 1 0.43866155 0.56133845 0.35429042 1.0 Cd Cd77 1 -0.00000000 0.00000000 0.25000000 1.0 Cd Cd78 1 0.60050563 0.20101127 0.05119097 1.0 Cd Cd79 1 0.79898873 0.39949437 0.44880903 1.0 Cd Cd80 1 0.73253512 0.46507023 0.75000000 1.0 Cd Cd81 1 0.39949437 0.79898873 0.94880903 1.0 Cd Cd82 1 0.66666700 0.33333300 0.90410308 1.0 Cd Cd83 1 0.23512866 0.47025733 0.84207067 1.0 Cd Cd84 1 0.76487134 0.23512866 0.15792933 1.0 Cd Cd85 1 0.27637707 0.35841317 0.25000000 1.0 Cd Cd86 1 0.39949437 0.60050563 0.55119097 1.0 Cd Cd87 1 0.36512475 0.03552259 0.10213869 1.0 Cd Cd88 1 0.76487134 0.23512866 0.34207067 1.0 Cd Cd89 1 0.81414904 0.90707452 0.15601179 1.0 Cd Cd90 1 0.32960216 0.96447741 0.89786131 1.0 Cd Cd91 1 0.87732311 0.43866155 0.85429042 1.0 Cd Cd92 1 0.90707452 0.81414904 0.65601179 1.0 Cd Cd93 1 0.12267689 0.56133845 0.14570958 1.0 Cd Cd94 1 0.96447741 0.32960216 0.39786131 1.0 Cd Cd95 1 0.64158683 0.72362293 0.25000000 1.0 Cd Cd96 1 0.56133845 0.43866155 0.85429042 1.0 Cd Cd97 1 0.47025733 0.23512866 0.15792933 1.0 Cd Cd98 1 0.80104662 0.80104662 0.50000000 1.0 Cd Cd99 1 -0.00000000 0.00000000 0.75000000 1.0 Cd Cd100 1 0.18585096 0.09292548 0.65601179 1.0 Cd Cd101 1 0.19895338 0.19895338 -0.00000000 1.0 Cd Cd102 1 0.19895338 0.00000000 0.50000000 1.0 Cd Cd103 1 0.08203611 0.35841317 0.25000000 1.0 Cd Cd104 1 0.67039784 0.63487525 0.39786131 1.0 Cd Cd105 1 0.52974267 0.76487134 0.65792933 1.0 Cd Cd106 1 0.79898873 0.39949437 0.05119097 1.0 Cd Cd107 1 0.36512475 0.32960216 0.10213869 1.0 Cd Cd108 1 0.23512866 0.76487134 0.84207067 1.0 Cd Cd109 1 0.66666700 0.33333300 0.25000000 1.0 Cd Cd110 1 0.43866155 0.87732311 0.14570958 1.0 Cd Cd111 1 0.50000000 0.50000000 -0.00000000 1.0 Cd Cd112 1 -0.00000000 0.50000000 0.50000000 1.0 Cd Cd113 1 0.23512866 0.76487134 0.65792933 1.0 Cd Cd114 1 0.33333300 0.66666700 0.40410308 1.0 Cd Cd115 1 0.19895338 0.00000000 -0.00000000 1.0 Cd Cd116 1 0.08203611 0.72362293 0.25000000 1.0 Cd Cd117 1 0.00000000 0.80104662 0.50000000 1.0 Cd Cd118 1 0.63487525 0.96447741 0.89786131 1.0 Cd Cd119 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd120 1 0.18585096 0.09292548 0.84398821 1.0 Cd Cd121 1 0.53492977 0.26746488 0.75000000 1.0 Cd Cd122 1 0.09292548 0.90707452 0.15601179 1.0 Cd Cd123 1 0.90707452 0.09292548 0.84398821 1.0 Cd Cd124 1 0.56133845 0.43866155 0.64570958 1.0 Cd Cd125 1 0.35841317 0.27637707 0.75000000 1.0 Cd Cd126 1 0.26746488 0.73253512 0.25000000 1.0 Cd Cd127 1 0.96447741 0.63487525 0.39786131 1.0 Cd Cd128 1 0.33333300 0.66666700 0.09589692 1.0 Cd Cd129 1 0.26746488 0.53492977 0.25000000 1.0 Cd Cd130 1 0.80104662 0.00000000 -0.00000000 1.0 Cd Cd131 1 0.64158683 0.91796389 0.25000000 1.0 Cd Cd132 1 0.50000000 0.00000000 -0.00000000 1.0 Cd Cd133 1 0.87732311 0.43866155 0.64570958 1.0 Cd Cd134 1 0.32960216 0.96447741 0.60213869 1.0 Cd Cd135 1 -0.00000000 0.50000000 -0.00000000 1.0 Cd Cd136 1 0.09292548 0.18585096 0.34398821 1.0 Cd Cd137 1 0.39949437 0.60050563 0.94880903 1.0 Cd Cd138 1 0.23512866 0.47025733 0.65792933 1.0 Cd Cd139 1 0.72362293 0.64158683 0.75000000 1.0 Cd Cd140 1 0.39949437 0.79898873 0.55119097 1.0 Cd Cd141 1 0.46507023 0.73253512 0.25000000 1.0